Sugi Predict

Sugi Predict / Compounds / SCHEMBL21800902

SCHEMBL21800902

SCHEMBL21800902

COc1ccccc1-n1ccc(-c2ccc(C(C)(C)C)cc2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 2/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ TUBB4A P04350 2/20 0.43
▸ TUBB P07437 2/20 0.43
▸ TUBA3C P0DPH7 2/20 0.43
▸ TUBA1B P68363 2/20 0.43
▸ TUBA4A P68366 2/20 0.43
▸ TUBB4B P68371 2/20 0.43
▸ TUBB3 Q13509 2/20 0.43
▸ TUBB2A Q13885 2/20 0.43
▸ TUBB8 Q3ZCM7 2/20 0.43
▸ TUBA3E Q6PEY2 2/20 0.43
▸ TUBA1A Q71U36 2/20 0.43
▸ TUBA1C Q9BQE3 2/20 0.43
▸ TUBB6 Q9BUF5 2/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6559666 0.85 TUBB4A (0.49) MEN1KMT2APOLBTSHRSMN1; SMN2
SCHEMBL28146751 0.73 KIF11 (0.44) NPSR1MEN1KMT2ALMNATSHR
SCHEMBL10145033 0.70 ALDH1A1 (0.52) NPSR1MEN1KMT2AAVPR2AVPR1A
SCHEMBL182259 0.69 TUBB4A (0.53) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL2098026 0.69 CA12 (0.52) MEN1KMT2ALMNATUBB4ATUBB
SCHEMBL16775439 0.68 RXRA (0.38) MEN1KMT2APOLBTUBB4ATUBB
SCHEMBL1623583 0.68 MAPT (0.45) NPSR1MEN1KMT2ALMNAPOLB
SCHEMBL11246111 0.66 MGLL (0.59) MEN1KMT2ALMNATUBB4ATUBB
SCHEMBL29303957 0.66 MTOR (0.44) NPSR1MEN1KMT2ALMNAPOLB
SCHEMBL14196932 0.66 KIF11 (0.47) LMNAPOLBTSHRALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11479566-B1 Compound and color conversion film comprising same LG CHEM, LTD. (KR) 2022-10-25 — — US disclosed
CN-110662751-B Compound and color conversion film comprising same 株式会社LG化学 2022-07-19 — — CN disclosed
CN-109563107-B Compound and color conversion film comprising same 株式会社LG化学 2022-02-22 — — CN disclosed
US-11091503-B2 Compound and color conversion film comprising the same LG CHEM, LTD. (KR) 2021-08-17 — — US disclosed
US-20200087324-A1 COMPOUND AND COLOR CONVERSION FILM COMPRISING THE SAME LG CHEM, LTD. (KR) 2020-03-19 — — US disclosed
CN-110662751-A Compound and color conversion film comprising same 株式会社LG化学 2020-01-07 — — CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11479566-B1 Compound and color conversion film comprising same CRY1, MYB, TRRAP NPSR1 4811/4885MEN1 407/4885KMT2A 852/4885
US-20200087324-A1 COMPOUND AND COLOR CONVERSION FILM COMPRISING THE SAME TRRAP, CDYL, MYB NPSR1 4814/4885MEN1 561/4885KMT2A 647/4885
US-11091503-B2 Compound and color conversion film comprising the same TRRAP, CDYL, MYB NPSR1 4814/4885MEN1 561/4885KMT2A 647/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.